N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C13H19N3O3 — CID 104772875

IUPACN-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOC1CC(N)C1NC(=O)c1ccc(C)[nH]c1=O
InChIInChI=1S/C13H19N3O3/c1-3-19-10-6-9(14)11(10)16-13(18)8-5-4-7(2)15-12(8)17/h4-5,9-11H,3,6,14H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyVQRITXKISGKRIS-UHFFFAOYSA-N
MW265.31 g/mol
LogP-0.08
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 104772875) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID104772875
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOC1CC(N)C1NC(=O)c1ccc(C)[nH]c1=O
InChIInChI=1S/C13H19N3O3/c1-3-19-10-6-9(14)11(10)16-13(18)8-5-4-7(2)15-12(8)17/h4-5,9-11H,3,6,14H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyVQRITXKISGKRIS-UHFFFAOYSA-N
XLogP-0.08
TPSA97.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-4-ethoxycyclobutyl)-2,4-dihydroxybenzamide
CID 66195669
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CID 66195102
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CID 66195121
N-(2-amino-4-ethoxycyclobutyl)-5-fluoro-2-methylbenzamide
CID 66196265
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-4-hydroxybenzamide
CID 107677163
N-(2-amino-4-ethoxycyclobutyl)-2-fluoro-5-methylbenzamide
CID 66196271
N-(2-amino-4-ethoxycyclobutyl)-4-bromo-2-hydroxybenzamide
CID 66197803
N-(2-amino-4-ethoxycyclobutyl)naphthalene-1-carboxamide
CID 66194914
N-(2-amino-4-ethoxycyclobutyl)-2-bromo-4-chlorobenzamide
CID 107990557
N-(2-amino-4-ethoxycyclobutyl)-2-chlorofuran-3-carboxamide
CID 106688549
N-(2-amino-4-ethoxycyclobutyl)-2-methylsulfanylbenzamide
CID 79217631
N-(2-amino-4-ethoxycyclobutyl)-2,5-difluorobenzamide
CID 66197031

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 104772875) is N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide is CCOC1CC(N)C1NC(=O)c1ccc(C)[nH]c1=O.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is VQRITXKISGKRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-3-19-10-6-9(14)11(10)16-13(18)8-5-4-7(2)15-12(8)17/h4-5,9-11H,3,6,14H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 265.31 g/mol, XLogP of -0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 104772875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).